Related entries (identical compound): KO001421 KO001420 PR100874 JP003539 JP011335 KO001417 KO001418 KO001419 JP011565

Submission id: KO001419

Outputs for (S)-Mandelic acid; LC-ESI-QQ; MS2; CE:30 V; [M-H]-

Database: Institute for Advanced Biosciences, Keio Univ.
Entry ID: KO001419
Synonyms: (S)-Mandelate, (S)-Mandelic acid, (S)-2-Hydroxy-2-phenylacetic acid, (S)-2-Hydroxy-2-phenylacetate
Total mass: 152.147
Formula: H8 C8 O3

Structure file (with ALATIS unique atom labels)

Experimental information

MS type: MS2
Instrument: API3000, Applied Biosystems
Instrument type: LC-ESI-QQ
Ionization mode: NEGATIVE

CAMP general report:

Acceptable mass threshold: 2.0158
Out of range queried mass peaks:
Replicated queried mass peaks: 108.3,
Processing time: 0:00:01.605411
Queried mass list: ['59.200', '77.200', '92.000', '105.100', '107.200', '133.000', '136.200']

Queried mass	Num. matched formulas	Num. matched fragments
59.2 (link to fragments)	2	16
77.2 (link to fragments)	2	13
92.0	No match found!	No match found!
105.1 (link to fragments)	1	1
107.2 (link to fragments)	2	4
133.0 (link to fragments)	2	8
136.2 (link to fragments)	2	8